C,1,56.31,s,
O,2,,,
C,3,151.83,s,
C,4,110.47,s,
C,5,138.21,s,
C,6,121.19,s,
C,7,147.14,s,
O,8,,,
C,9,135.77,s,
O,10,,,
C,11,60.52,s,
C,12,121.19,s,
C,13,144.14,s,
O,14,,,
C,15,60.98,s,
C,16,151.32,s,
O,17,,,
C,18,55.67,s,
C,19,111.02,s,
C,20,128.8,s,
C,21,127.11,s,
C,22,61.76,s,
C,23,31.15,s,
C,24,30.0,s,
N,25,,,
C,26,42.86,s,
C,27,49.63,s,
C,28,28.19,s,
H,29,3.87,s,
H,30,3.87,s,
H,31,3.87,s,
H,32,6.68,s,
H,33,,,
H,34,3.88,s,
H,35,3.88,s,
H,36,3.88,s,
H,37,3.78,s,
H,38,3.78,s,
H,39,3.78,s,
H,40,3.81,s,
H,41,3.81,s,
H,42,3.81,s,
H,43,6.66,s,
H,44,4.75,dd,"12.4,4.4"
H,45,1.84,m,
H,46,1.84,tdd,"12.4,11.1,1.7"
H,47,2.45,ddd,"13.4,11.1,1.2"
H,48,2.45,ddd,"13.4,8.8,1.7"
H,49,2.35,s,
H,50,2.35,s,
H,51,2.35,s,
H,52,2.78,ddd,"13.1,12.4,3.5"
H,53,2.78,ddd,"12.4,3.0,2.5"
H,54,2.85,ddd,"15.4,3.5,2.5"
H,55,2.85,ddd,"15.4,13.1,3.0"
